2-pentan-3-yl-1,2-benzothiazol-3-one

Systemtic Name: 2-pentan-3-yl-1,2-benzothiazol-3-one Openeye Name: 2-(1-ethylpropyl)-1,2-benzothiazol-3-one CAS Name: 2-pentan-3-yl-1,2-benzothiazol-3-one IUPAC Name: 2-pentan-3-yl-1,2-benzothiazol-3-one Traditional Name: 2-(1-ethylpropyl)-1,2-benzothiazol-3-one Formula: C12H15NOS MolecularWeight: 221.3186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=O)C2=CC=CC=C2S1

Isomeric SMILES

CCC(CC)N1C(=O)C2=CC=CC=C2S1

InChI

InChI=1S/C12H15NOS/c1-3-9(4-2)13-12(14)10-7-5-6-8-11(10)15-13/h5-9H,3-4H2,1-2H3